5-nitro-N-[(1-prop-2-ynylindol-3-yl)methylideneamino]-1-benzothiophene-2-carboxamide

Systemtic Name: 5-nitro-N-[(1-prop-2-ynylindol-3-yl)methylideneamino]-1-benzothiophene-2-carboxamide Openeye Name: 5-nitro-N-[(1-prop-2-ynylindol-3-yl)methyleneamino]benzothiophene-2-carboxamide CAS Name: 5-nitro-N-[(1-prop-2-ynyl-3-indolyl)methylideneamino]-1-benzothiophene-2-carboxamide IUPAC Name: 5-nitro-N-[(1-prop-2-ynylindol-3-yl)methylideneamino]-1-benzothiophene-2-carboxamide Traditional Name: 5-nitro-N-[(1-propargylindol-3-yl)methyleneamino]benzothiophene-2-carboxamide Formula: C21H14N4O3S MolecularWeight: 402.42586

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C=C(C2=CC=CC=C21)C=NNC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C#CCN1C=C(C2=CC=CC=C21)C=NNC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H14N4O3S/c1-2-9-24-13-15(17-5-3-4-6-18(17)24)12-22-23-21(26)20-11-14-10-16(25(27)28)7-8-19(14)29-20/h1,3-8,10-13H,9H2,(H,23,26)